CAS 1240529-52-5

Phenylmethyl 2-[(chlorosulfonyl)methyl]-1-pyrrolidinecarboxylate

Description:

Phenylmethyl 2-[(chlorosulfonyl)methyl]-1-pyrrolidinecarboxylate, identified by its CAS number 1240529-52-5, is a chemical compound that features a pyrrolidine ring, which is a five-membered nitrogen-containing heterocycle. This compound is characterized by the presence of a chlorosulfonyl group, which contributes to its reactivity and potential applications in organic synthesis. The ester functional group, indicated by the carboxylate moiety, suggests that it may participate in various chemical reactions, including nucleophilic substitutions and esterifications. The phenylmethyl group adds to its structural complexity and may influence its solubility and interaction with biological systems. Due to the presence of both sulfonyl and ester functionalities, this compound may exhibit unique properties, making it of interest in medicinal chemistry and material science. However, specific safety and handling guidelines should be followed, as compounds containing chlorosulfonyl groups can be hazardous. Overall, this compound's unique structure positions it as a potentially valuable intermediate in synthetic chemistry.

Formula: C₁₃H₁₆ClNO₄S

InChI: InChI=1S/C13H16ClNO4S/c14-20(17,18)10-12-7-4-8-15(12)13(16)19-9-11-5-2-1-3-6-11/h1-3,5-6,12H,4,7-10H2

InChI key: InChIKey=WFSXSKWRWQOOAY-UHFFFAOYSA-N

SMILES: C(OCC1=CC=CC=C1)(=O)N2C(CS(Cl)(=O)=O)CCC2

Synonyms:

• Phenylmethyl 2-[(chlorosulfonyl)methyl]-1-pyrrolidinecarboxylate
• 1-Pyrrolidinecarboxylic acid, 2-[(chlorosulfonyl)methyl]-, phenylmethyl ester

Benzyl 2-[(chlorosulfonyl)methyl]pyrrolidine-1-carboxylate

CAS: 1240529-52-5

Versatile small molecule scaffold

Formula: C₁₃H₁₆ClNO₄S

Purity: Min. 95%

Molecular weight: 317.79 g/mol

Ref: 3D-QZB52952